5-ethynyl-2,2-dimethyl-4H-1,3-benzodioxine

Systemtic Name: 5-ethynyl-2,2-dimethyl-4H-1,3-benzodioxine Openeye Name: 5-ethynyl-2,2-dimethyl-4H-1,3-benzodioxine CAS Name: 5-ethynyl-2,2-dimethyl-4H-1,3-benzodioxin IUPAC Name: 5-ethynyl-2,2-dimethyl-4H-1,3-benzodioxine Traditional Name: 5-ethynyl-2,2-dimethyl-4H-1,3-benzodioxin Formula: C12H12O2 MolecularWeight: 188.22248

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC2=C(C=CC=C2O1)C#C)C

Isomeric SMILES

CC1(OCC2=C(C=CC=C2O1)C#C)C

InChI

InChI=1S/C12H12O2/c1-4-9-6-5-7-11-10(9)8-13-12(2,3)14-11/h1,5-7H,8H2,2-3H3